N2-[4-(dimethylamino)cyclohexyl]-N8-(2-fluorophenyl)-9-piperidin-4-yl-purine-2,8-diamine

Systemtic Name: N2-[4-(dimethylamino)cyclohexyl]-N8-(2-fluorophenyl)-9-piperidin-4-yl-purine-2,8-diamine Openeye Name: N2-[4-(dimethylamino)cyclohexyl]-N8-(2-fluorophenyl)-9-(4-piperidyl)purine-2,8-diamine CAS Name: N2-[4-(dimethylamino)cyclohexyl]-N8-(2-fluorophenyl)-9-(4-piperidinyl)purine-2,8-diamine IUPAC Name: 2-N-[4-(dimethylamino)cyclohexyl]-8-N-(2-fluorophenyl)-9-piperidin-4-ylpurine-2,8-diamine Traditional Name: [4-[[8-(2-fluoroanilino)-9-(4-piperidyl)purin-2-yl]amino]cyclohexyl]-dimethyl-amine Formula: C24H33FN8 MolecularWeight: 452.570823

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCC(CC1)NC2=NC=C3C(=N2)N(C(=N3)NC4=CC=CC=C4F)C5CCNCC5

Isomeric SMILES

CN(C)C1CCC(CC1)NC2=NC=C3C(=N2)N(C(=N3)NC4=CC=CC=C4F)C5CCNCC5

InChI

InChI=1S/C24H33FN8/c1-32(2)17-9-7-16(8-10-17)28-23-27-15-21-22(31-23)33(18-11-13-26-14-12-18)24(30-21)29-20-6-4-3-5-19(20)25/h3-6,15-18,26H,7-14H2,1-2H3,(H,29,30)(H,27,28,31)